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N-(2-Iodophenyl)-8-methyl[1,2,5]oxadiazolo[3,4-E][1,2,4]triazolo[4,3-a]pyrazin-5-amine
SpectraBase Compound ID 6cW7OVCYkvu
InChI InChI=1S/C12H8IN7O/c1-6-16-17-11-9(14-8-5-3-2-4-7(8)13)15-10-12(20(6)11)19-21-18-10/h2-5H,1H3,(H,14,15,18)
InChIKey SSDXYXBPTGUXJV-UHFFFAOYSA-N
Mol Weight 393.15 g/mol
Molecular Formula C12H8IN7O
Exact Mass 392.983503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Ge0PmFc5HX
Name N-(2-Iodophenyl)-8-methyl[1,2,5]oxadiazolo[3,4-E][1,2,4]triazolo[4,3-a]pyrazin-5-amine
CAS Registry Number 305858-79-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H8IN7O
InChI InChI=1S/C12H8IN7O/c1-6-16-17-11-9(14-8-5-3-2-4-7(8)13)15-10-12(20(6)11)19-21-18-10/h2-5H,1H3,(H,14,15,18)
InChIKey SSDXYXBPTGUXJV-UHFFFAOYSA-N
Molecular Weight 393.148 g/mol
SMILES N(C=1c2[n](-c3c(non3)N1)c(nn2)C)c1c(cccc1)I
SPLASH splash10-016r-9670000000-20c96efcf7b497aae8e1
Synonyms (2-Iodo-phenyl)-(8-methyl-2-oxa-1,3,4,6,7,8a-hexaaza-as-indacen-5-yl)-amine
Wiley ID 1461618